1,3-bis(morpholin-4-ylmethyl)-4-nitro-benzimidazole-2-thione

Systemtic Name: 1,3-bis(morpholin-4-ylmethyl)-4-nitro-benzimidazole-2-thione Openeye Name: 1,3-bis(morpholinomethyl)-4-nitro-benzimidazole-2-thione CAS Name: 1,3-bis(4-morpholinylmethyl)-4-nitro-2-benzimidazolethione IUPAC Name: 1,3-bis(morpholin-4-ylmethyl)-4-nitrobenzimidazole-2-thione Traditional Name: 1,3-bis(morpholinomethyl)-4-nitro-benzimidazole-2-thione Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C3=C(C(=CC=C3)[N+](=O)[O-])N(C2=S)CN4CCOCC4

Isomeric SMILES

C1COCCN1CN2C3=C(C(=CC=C3)[N+](=O)[O-])N(C2=S)CN4CCOCC4

InChI

InChI=1S/C17H23N5O4S/c23-22(24)15-3-1-2-14-16(15)21(13-19-6-10-26-11-7-19)17(27)20(14)12-18-4-8-25-9-5-18/h1-3H,4-13H2